methyl 4-[(E)-4-piperidin-1-ylbut-3-enyl]benzoate

Systemtic Name: methyl 4-[(E)-4-piperidin-1-ylbut-3-enyl]benzoate Openeye Name: methyl 4-[(E)-4-(1-piperidyl)but-3-enyl]benzoate CAS Name: 4-[(E)-4-(1-piperidinyl)but-3-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-4-piperidin-1-ylbut-3-enyl]benzoate Traditional Name: 4-[(E)-4-piperidinobut-3-enyl]benzoic acid methyl ester Formula: C17H23NO2 MolecularWeight: 273.37002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCC=CN2CCCCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC/C=C/N2CCCCC2

InChI

InChI=1S/C17H23NO2/c1-20-17(19)16-10-8-15(9-11-16)7-3-6-14-18-12-4-2-5-13-18/h6,8-11,14H,2-5,7,12-13H2,1H3/b14-6+